* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    113    162     325
    1     0 S   NP   _N1_     1    28.93941    93.31092   -21.61490
    2     1 S   H    _HN1     2     1.02772    87.29287   -88.96140
    3     1 S   H    _H1_     3     1.03220    99.47632    18.59603
    4     1 S   H    _H2_     4     1.02826    25.98048   128.29502
    5     1 S   CT   _CA1     5     1.50035   135.35958   151.79224
    6     5 S   HC   _HA1     6     1.09584   105.25636    50.79357
    7     5 S   CO3  _C1_     7     1.53883   112.08647   -69.30021
    8     7 S   O2Z  _O11     8     1.26322   115.29735   -58.93331
    9     7 S   O2Z  _O12     9     1.26251   114.75360   120.22381
   10     5 S   CT   _CB1    10     1.53020   107.45248   168.40582
   11    10 S   HC   HB11    11     1.09816   109.67499   -50.34121
   12    10 S   HC   HB12    12     1.09690   110.30131    66.29208
   13    10 S   CT   _CG1    13     1.52998   112.70786  -171.66874
   14    13 S   HC   HG11    14     1.09594   110.43360   -56.37979
   15    13 S   HC   HG12    15     1.09600   110.24003    62.97305
   16    13 S   C    _CD1    16     1.51746   111.68214  -176.64585
   17    16 S   O    _OE1    17     1.22767   123.05797   -10.45929
   18    16 S   N    _N2_    18     1.38610   111.93093   169.47176
   19    18 S   H    _HN2    19     1.01587   119.25184     2.42115
   20    18 S   CT1  _CA2    20     1.46123   122.99396  -176.06876
   21    20 S   HC   _HA2    21     1.09579   109.06302   -13.08805
   22    20 S   C    _C2_    22     1.53361   108.90675  -128.46467
   23    22 S   O    _O2_    23     1.23023   122.11108  -147.80424
   24    20 S   CT   _CB2    32     1.53581   111.68149   108.98692
   25    24 S   HC   HB21    33     1.09657   109.47725    63.55743
   26    24 S   HC   HB22    34     1.09568   111.03406  -179.02823
   27    22 S   N    _N3_    24     1.38475   113.43994    39.76147
   28    27 S   H    _HN3    25     1.01522   118.93495    -0.73675
   29    24 S   S    _SG2    35     1.82834   114.33809   -55.80245
   30    27 S   CT   _CA3    26     1.45443   123.39781   174.75029
   31    30 S   HC   HA31    27     1.09526   109.18538    25.52886
   32    30 S   HC   HA32    28     1.09493   107.14340   142.55029
   33    29 S   CT   _C10    36     1.82560    99.94017   -73.85707
   34    33 S   HC   _H14    37     1.09385   110.55578    42.93660
   35    33 S   HC   _H15    38     1.09471   108.02122   -75.06443
   36    30 S   CO3  _C3_    29     1.52937   113.12683   -97.88902
   37    36 S   O2Z  _O31    30     1.26401   115.42047   -43.74136
   38    36 S   O2Z  _O32    31     1.26356   114.96969   137.17578
   39    33 S   CT   _C9_    39     1.53016   110.90441   164.88335
   40    39 S   HC   _H12    40     1.09563   108.57848   171.69707
   41    39 S   HC   _H13    41     1.09615   110.65088    54.19630
   42    39 S   NX   _N5_    42     1.46098   111.37883   -68.75606
   43    42 S   H    _H11    43     1.01920   109.08003    43.67560
   44    42 S   P1   _P1_    44     1.65384   119.39255  -179.82306
   45    44 S   O2Z  _O34    45     1.50625   115.88004    49.21442
   46    44 S   N    _N4_    46     1.73901   106.02240   174.31328
   47    46 S   C    _C6_    47     1.39415   122.90207   113.09856
   48    47 S   O    _O35    48     1.23419   123.62954  -179.69674
   49    46 S   CT   _C7_    56     1.46759   118.59655   -67.39759
   50    49 S   HC   _H7_    57     1.09512   108.02751    28.89234
   51    49 S   HC   _H8_    58     1.09609   108.85462   145.32056
   52    47 S   CT   _C4_    49     1.51422   116.73199     3.63545
   53    52 S   HC   _H3_    50     1.09611   107.12046    84.38621
   54    52 S   HC   _H4_    51     1.09526   108.03280  -158.90667
   55    49 S   CT   _C8_    59     1.52146   111.31112   -92.94430
   56    55 S   Cl   Cl1_    60     1.77746   110.34987  -179.65736
   57    55 S   HC   _H9_    61     1.09390   111.32445    60.64014
   58    55 S   HC   _H10    62     1.09433   111.36271   -59.95195
   59    52 S   CT   _C5_    52     1.51101   112.77794   -37.80910
   60    59 S   HC   _H5_    53     1.09374   110.59571  -173.51871
   61    59 S   HC   _H6_    54     1.09487   112.48942   -51.97923
   62    44 S   OS   _O33    55     1.62225   105.60272   -73.97308
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   7   5   4   3
   8   5   4   2   1   1   8   4   3   8   4  13   5  14  12   5
   8   5   4   6   5   4   3   2   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    62  
   41    42    43    44  
   42    43    44  
   43    44    45    46    47    59    62    49  
   44    45    46    62  
   45    46    47    48    52    59    60    61    62    49    50    51    55  
   46    47    59    62    49  
   47    48    52    53    54    59    62    49    50    51    55    56    57    58  
   48    52    53    54    59    60    61    62    49    50    51    55  
   52    53    54    59    49  
   50    51    55    56    57    58    52    62  
   51    55    56    57    58  
   55    56    57    58  
   53    54    59    60    61    62  
   54    59    60    61    62  
   59    60    61    62  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62  
   61    62  
   62  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060200   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.566600   1.8100   1.6000   0.054801302  -1.445846770
   43   0.5000   0.0300   0.294300   0.9960   0.8600   0.030040813  -0.651083722
   44   3.7400   0.2000   1.279300   2.1070   1.8700   0.005000000   0.000000000
   45   2.9800   0.2000  -0.666100   1.6890   1.4900   0.001000000  -0.126889456
   46   3.2500   0.1700  -0.457500   1.8100   1.6000   0.054801302  -1.445846770
   47   3.7500   0.1050   0.622500   1.9250   1.7000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   49   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.006000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   57   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   310.000  1.452
   42    43   505.000  1.018
   42    44   305.000  1.702
   44    45   675.000  1.490
   44    46   290.000  1.710
   44    62   405.000  1.623
   46    47   490.000  1.335
   46    49   337.000  1.449
   47    48   570.000  1.229
   47    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   320.000  1.410
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    55   268.000  1.529
   55    56   245.000  1.781
   55    57   340.000  1.090
   55    58   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    75.00000  110.98300
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    42    43    50.00000  108.89700
   39    42    44    60.00000  116.07500
   41    39    40    33.00000  107.80000
   42    39    40    50.00000  110.67200
   42    39    41    50.00000  110.67200
   42    44    45    85.00000  116.90400
   42    44    46    90.00000  101.80600
   42    44    62   105.00000  102.60700
   44    42    43    40.00000  115.80200
   44    46    47    55.00000  124.94500
   44    46    49    55.00000  124.56000
   44    62    59    75.00000  119.24600
   46    44    45    85.00000  113.20000
   46    47    48    80.00000  122.90000
   46    47    52    70.00000  116.60000
   46    49    50    35.00000  109.50000
   46    49    51    35.00000  109.50000
   46    49    55    70.00000  110.72300
   47    52    53    35.00000  109.50000
   47    52    54    35.00000  109.50000
   47    52    59    63.00000  111.10000
   52    47    48    80.00000  120.40000
   52    59    60    37.50000  110.70000
   52    59    61    37.50000  110.70000
   52    59    62    50.00000  109.50000
   54    52    53    33.00000  107.80000
   59    52    53    37.50000  110.70000
   59    52    54    37.50000  110.70000
   61    59    60    33.00000  107.80000
   62    44    45   100.00000  115.86100
   62    44    46   105.00000  101.75000
   62    59    60    35.00000  109.50000
   62    59    61    35.00000  109.50000
   49    46    47    50.00000  121.90000
   49    55    56    69.00000  109.80000
   49    55    57    37.50000  110.70000
   49    55    58    37.50000  110.70000
   51    49    50    33.00000  107.80000
   55    49    50    37.50000  110.70000
   55    49    51    37.50000  110.70000
   57    55    56    51.00000  107.60000
   58    55    56    51.00000  107.60000
   58    55    57    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    36    37   0.00000  1.0 1.0
   27    30    36    38   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    39    42    43   0.14900  1.0 1.0
   33    39    42    43  -0.14450 -1.0 2.0
   33    39    42    43  -0.19400  1.0 3.0
   33    39    42    44  -2.23400  1.0 1.0
   33    39    42    44  -0.50500 -1.0 2.0
   33    39    42    44   0.66300  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    42   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    42   0.15000  1.0 3.0
   39    42    44    45   0.00000  1.0 1.0
   39    42    44    46   0.25000  1.0 3.0
   39    42    44    62   0.29300  1.0 1.0
   39    42    44    62  -1.33650 -1.0 2.0
   39    42    44    62   0.62200  1.0 3.0
   40    39    42    43   0.20000  1.0 3.0
   40    39    42    44   0.05900  1.0 3.0
   41    39    42    43   0.20000  1.0 3.0
   41    39    42    44   0.05900  1.0 3.0
   42    44    46    47   0.00000  1.0 1.0
   42    44    46    49   0.00000  1.0 1.0
   42    44    62    59  -0.14600  1.0 1.0
   42    44    62    59  -0.87400 -1.0 2.0
   42    44    62    59   0.68500  1.0 3.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    46   0.25000  1.0 3.0
   43    42    44    62   0.07350  1.0 1.0
   43    42    44    62  -1.26400 -1.0 2.0
   43    42    44    62   0.45050  1.0 3.0
   44    46    47    48   2.45000 -1.0 2.0
   44    46    47    52   2.45000 -1.0 2.0
   44    46    49    50   0.00000  1.0 1.0
   44    46    49    51   0.00000  1.0 1.0
   44    46    49    55   0.17850 -1.0 2.0
   45    44    46    47   0.00000  1.0 1.0
   45    44    46    49   0.00000  1.0 1.0
   45    44    62    59   0.00000  1.0 1.0
   46    44    62    59   0.15000  1.0 3.0
   46    47    52    53   0.00000  1.0 1.0
   46    47    52    54   0.00000  1.0 1.0
   46    47   -52    59   1.39750  1.0 1.0
   46    47   -52    59  -0.07950 -1.0 2.0
   46    47   -52    59  -0.18750  1.0 3.0
   46    49    55    56   0.56750  1.0 1.0
   46    49    55    56  -0.07550 -1.0 2.0
   46    49    55    56   0.20000  1.0 3.0
   46    49    55    57   0.15000  1.0 3.0
   46    49    55    58   0.15000  1.0 3.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    51   0.00000  1.0 1.0
   47    46    49    55  -0.43950  1.0 1.0
   47    46    49    55  -0.08100 -1.0 2.0
   47    46    49    55   0.03350  1.0 3.0
   47    52    59    60  -0.11250  1.0 3.0
   47    52    59    61  -0.11250  1.0 3.0
   47    52    59    62  -0.09450  1.0 1.0
   47    52    59    62  -1.12950 -1.0 2.0
   47    52    59    62   0.54000  1.0 3.0
   48    47    52    53   0.00000  1.0 1.0
   48    47    52    54   0.00000  1.0 1.0
   48    47    52    59   0.30150 -1.0 2.0
   52    59   -62    44  -2.65550  1.0 1.0
   52    59   -62    44  -0.22350 -1.0 2.0
   52    59   -62    44   0.24150  1.0 3.0
   53    52    59    60   0.15000  1.0 3.0
   53    52    59    61   0.15000  1.0 3.0
   53    52    59    62   0.23400  1.0 3.0
   54    52    59    60   0.15000  1.0 3.0
   54    52    59    61   0.15000  1.0 3.0
   54    52    59    62   0.23400  1.0 3.0
   60    59    62    44   0.03000  1.0 3.0
   61    59    62    44   0.03000  1.0 3.0
   62    44   -46    47   0.00000  1.0 1.0
   62    44    46    49   0.00000  1.0 1.0
   49    46    47    48   3.04450 -1.0 2.0
   49    46    47    52   1.49850  1.0 1.0
   49    46    47    52   1.53950 -1.0 2.0
   50    49    55    56   0.27000  1.0 3.0
   50    49    55    57   0.15000  1.0 3.0
   50    49    55    58   0.15000  1.0 3.0
   51    49    55    56   0.27000  1.0 3.0
   51    49    55    57   0.15000  1.0 3.0
   51    49    55    58   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   43    44    42    39   1.00000 -1.0 2.0
   49    44    46    47   1.00000 -1.0 2.0
   46    52    47    48  10.50000 -1.0 2.0
END
